N-benzyl-5-[(3-chloro-4-methylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-benzyl-5-[(3-chloro-4-methylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
N-benzyl-5-[(3-chloro-4-methylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L268-0813 |
| Compound Name: | N-benzyl-5-[(3-chloro-4-methylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 613.05 |
| Molecular Formula: | C25 H27 Cl N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(cc1[Cl])S(Nc1ccc(c(c1)C(NCc1ccccc1)=O)N1CCNCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3235 |
| logD: | 2.848 |
| logSw: | -4.539 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.413 |
| InChI Key: | ZICAVAIAVMFNRF-UHFFFAOYSA-N |